(1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol

C10H19NO — CID 156651642

IUPAC(1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol
SMILESC=C(C)N1CCC[C@H]([C@H](C)O)C1
InChIInChI=1S/C10H19NO/c1-8(2)11-6-4-5-10(7-11)9(3)12/h9-10,12H,1,4-7H2,2-3H3/t9-,10-/m0/s1
InChIKeyAJFIEIRRSBBNMM-UWVGGRQHSA-N
MW169.27 g/mol
LogP1.61
Rot. Bonds2

About (1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol

(1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol (PubChem CID 156651642) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol.

Molecular Properties

Compound Name(1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol
PubChem CID156651642
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol
SMILESC=C(C)N1CCC[C@H]([C@H](C)O)C1
InChIInChI=1S/C10H19NO/c1-8(2)11-6-4-5-10(7-11)9(3)12/h9-10,12H,1,4-7H2,2-3H3/t9-,10-/m0/s1
InChIKeyAJFIEIRRSBBNMM-UWVGGRQHSA-N
XLogP1.61
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-Propylpiperidin-3-yl)ethan-1-ol
CID 21317077
1-(1-Methylpiperidin-3-yl)ethanol
CID 43498318
1-(1-Ethylpiperidin-3-yl)ethanol
CID 43498319
1-[(3S)-1-methylpiperidin-3-yl]ethanol
CID 59861737
1-[(3R)-1-methylpiperidin-3-yl]ethanol
CID 59861740
1-(1-Propan-2-ylpiperidin-3-yl)ethanol
CID 59861745
1-(1-Butylpiperidin-3-yl)ethanol
CID 67829617
(5-Methyl-1-prop-1-en-2-ylpiperidin-3-yl)methanol
CID 141835949
2-(1-Prop-1-en-2-ylpiperidin-4-yl)ethanol
CID 147010900
(1S)-1-[(3R)-1-methylpiperidin-3-yl]ethanol
CID 147071920
2,2-Dimethyl-1-prop-1-en-2-ylpiperidin-4-ol
CID 153592542
(1-Prop-1-en-2-ylpiperidin-3-yl)methanol
CID 154986403

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol?
The IUPAC name of (1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol (CID 156651642) is (1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol.
What is the SMILES notation for (1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol?
The canonical SMILES for (1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol is C=C(C)N1CCC[C@H]([C@H](C)O)C1.
What is the InChIKey of (1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol?
The InChIKey is AJFIEIRRSBBNMM-UWVGGRQHSA-N. The full InChI is InChI=1S/C10H19NO/c1-8(2)11-6-4-5-10(7-11)9(3)12/h9-10,12H,1,4-7H2,2-3H3/t9-,10-/m0/s1.
What are the key properties of (1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol?
(1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol has a molecular weight of 169.27 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol is sourced from PubChem (CID 156651642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).